(Q105229870)

English

(1S,4aR,8aS)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-1,4a,6-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-1-carbaldehyde

chemical compound

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instance of

type of chemical entity

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subclass of

5-(3-Hydroxy-3-methylpent-4-enyl)-1,4a,6-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-1-carbaldehyde

1 reference

based on heuristic

inferred from SMILES

mass

304.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,4aS,8aR)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-1,4a,6-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-1-carbaldehyde

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O₂

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canonical SMILES

O=CC1(C)CCCC2(C(=C(C)CCC12)CCC(O)(C=C)C)C

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isomeric SMILES

C=C[C@@](C)(O)CCC1=C(C)CC[C@@H]2[C@@](C)(C=O)CCC[C@@]12C

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found in taxon

Araucaria columnaris

1 reference

stated in

New labdane diterpenes from Araucaria cooki

Araucaria cookii

1 reference

stated in

New labdane diterpenes from Araucaria cooki

Identifiers

InChI

InChI=1S/C20H32O2/c1-6-19(4,22)13-10-16-15(2)8-9-17-18(3,14-21)11-7-12-20(16,17)5/h6,14,17,22H,1,7-13H2,2-5H3/t17-,18-,19-,20+/m1/s1

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InChIKey

QXSIOZLWDLOGDE-WTGUMLROSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QXSIOZLWDLOGDE-WTGUMLROSA-N

(Q105229870)

(1S,4aR,8aS)-5-[(3S)-3-hydroxy-3-methylpent-4-enyl]-1,4a,6-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-1-carbaldehyde

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